AC1LZ5KV
methyl 4-[(3-cyano-6-methyl-4-thiophen-2-yl-7,8-dihydro-5H-1,6-naphthyridin-2-yl)sulfanyl]-3-oxobutanoate
Also Known As: Oprea1_428098|SS-0775|KS-00003S52|AM-807/13103157|methyl 4-{[3-cyano-6-methyl-4-(thiophen-2-yl)-5,6,7,8-tetrahydro-1,6-naphthyridin-2-yl]sulfanyl}-3-oxobutanoate|methyl 4-{[3-cyano-6-methyl-4-(2-thienyl)-5,6,7,8-tetrahydro[1,6]naphthyridin-2-yl]sulfanyl}-3-oxobutanoate|Methyl 4-((3-cyano-6-methyl-4-(thiophen-2-yl)-5,6,7,8-tetrahydro-1,6-naphthyridin-2-yl)thio)-3-oxobutanoate|methyl 4-[(3-cyano-6-methyl-4-thiophen-2-yl-7,8-dihydro-5H-1,6-naphthyridin-2-yl)sulfanyl]-3-oxobutanoate|methyl4-{[3-cyano-6-methyl-4-(thiophen-2-yl)-5,6,7,8-tetrahydro-1,6-naphthyridin-2-yl]sulfanyl}-3-oxobutanoate
| Molecular Formula | C19H19N3O3S2 |
|---|---|
| Molecular Weight | 401.0868 g/mol |
| LogP | 2.89398 |
| Topological Polar Surface Area | 83.29 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 401.0868 |
| Monoisotopic Mass | 401.0868 |
| Heavy Atoms | 27 |
| Complexity | 903.90906 |
Chemical Identifiers
| CAS Number | 354554-86-2 |
|---|---|
| SMILES | CN1CCC2=C(C1)C(=C(C(=N2)SCC(=O)CC(=O)OC)C#N)C3=CC=CS3 |
Product Overview
AC1LZ5KV (CAS 354554-86-2), with molecular formula C19H19N3O3S2 and molecular weight 401.0868 g/mol. IUPAC: methyl 4-[(3-cyano-6-methyl-4-thiophen-2-yl-7,8-dihydro-5H-1,6-naphthyridin-2-yl)sulfanyl]-3-oxobutanoate.